Vitas-M small molecule compound
methyl 2-{[(pyridin-4-ylcarbonyl)carbamothioyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK558123
SMILES COC(=O)c1c(NC(=S)NC(=O)c2ccncc2)sc2c1CCCCCC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H21N3O3S2 MW 403.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O3S2/c1-25-18(24)15-13-6-4-2-3-5-7-14(13)27-17(15)22-19(26)21-16(23)12-8-10-20-11-9-12/h8-11H,2-7H2,1H3,(H2,21,22,23,26)InChIKey
WCGWUJPJBDKBDN-UHFFFAOYSA-NSynonyms
585558-78-7585558787
COC(=O)C1=C(SC2=C1CCCCCC2)NC(=S)NC(=O)C3=CC=NC=C3
InChI=1SC19H21N3O3S2c12518(24)151364235714(13)2717(15)2219(26)2116(23)128102011912h811H27H21H3(H221222326)
methyl2(((pyridin4ylcarbonyl)carbamothioyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
methyl2(3isonicotinoylthioureido)456789hexahydrocycloocta(b)thiophene3carboxylate
methyl2(pyridine4carbonylcarbamothioylamino)456789hexahydrocycloocta(b)thiophene3carboxylate
MFCD03820287
ZINC000002392167
ZINC02392167
ZINC2392167
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